| ID | Name | CAS | Data |
McVol (ml/mol) |
| 46-413-2 |
L-Aspartic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester
|
|
5 | 282.690 |
| 46-483-5 |
Perhydrophenanthrene, 1A-(3R/S-methyloctyl)-2A,4bB,8,8,10aB-pentamethyl
|
|
5 | 372.800 |
| 46-512-2 |
3«alpha»,6«beta»,7«beta»,12«beta»-Tetrahydroxy-5«beta»-cholanoic acid, acetate-methyl ester
|
|
5 | 469.590 |
| 46-513-1 |
4,7-DIPHENYL-3A,4,7,7A-TETRAHYDROISOBENZOFURAN-1,3-DIONE
|
|
5 | 228.130 |
| 46-521-2 |
Benzo[1,2-c:3,4-c':5,6-c'']tris[1,2,5]oxadiazole, 1,4,7-trioxide
|
3470-17-5 |
5 | 121.260 |
| 46-631-0 |
2,2,3,3,4,4,4-Heptafluoro-N-[[4-[(2,2,3,3,4,4,4-heptafluorobutanoylamino)methyl]phenyl]methyl]butanamide
|
|
5 | 260.420 |
| 46-783-2 |
Perhydrophenanthrene, 1A-(3R/S,7-dimethyloctyl)-2A,4bB,8,8,10aB-pentamethyl
|
|
5 | 386.890 |
| 47-105-3 |
Glutaric acid, monochloride , 2,2,3,3,4,4,5,5-octafluoropentyl ester
|
|
5 | 187.170 |
| 47-178-3 |
Bicyclo[3.1.1]heptane, 2,6,6-trimethyl, 2,3-bis-(methylthio)
|
|
5 | 190.920 |
| 47-232-2 |
Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl 4-isopropylphenyl ester
|
|
5 | 253.900 |
| 47-388-0 |
2-exo,5,5,8c,9b,9c,10a,10b-octachlorobornane
|
|
5 | 227.960 |
| 47-645-4 |
Tetracyclo[3.3.2.02,4.06,8]dec-9-ene (1«alpha»,4«alpha»,6«alpha»,8«alpha»)-
|
27367-72-2 |
5 | 160.380 |
| 47-675-1 |
2«alpha»-Isopropenyl-6«alpha»-isopropyl-3«alpha»-methyl-3«alpha»-vinylcyclohexanone
|
|
5 | 204.320 |
| 47-719-2 |
1,3,6,8-Tetraazatricyclo[4.4.1.1(3,8)]dodecane
|
|
5 | 130.920 |
| 47-784-0 |
4a«alpha»,4b«beta»-Gibbane-1«alpha»,10«beta»-dicarboxylic acid, 4a-formyl-1-methyl-8-methylene-, dimethyl ester
|
19427-33-9 |
5 | 289.550 |
| 47-820-9 |
l-Cysteine, N,S-bis(2,3,4-trifluorobenzoyl)-, methyl ester
|
|
5 | 264.490 |
| 47-854-2 |
Naphthalene,1,2,3,4,4a,5,6,8a-octahydro-8a-methoxy-4a-methyl-cis-
|
|
5 | 159.790 |
| 48-019-8 |
cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, diacetate
|
|
5 | 235.070 |
| 48-076-5 |
22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester
|
|
5 | 400.790 |
| 48-138-6 |
12-nor-Ziza-6(13)-en-2-.alpha.-yl methyl ether
|
|
5 | 191.200 |
| 48-165-6 |
Fumaric acid, monoamide, N-benzyl-N-phenethyl-, 2-pentyl ester
|
|
5 | 316.190 |
| 48-348-3 |
(-)-(1R,3R,6S,10S)-3«alpha»-Acetoxyamorpha-4,7(11)-diene
|
|
5 | 227.510 |
| 48-455-4 |
2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, I
|
|
5 | 214.530 |
| 48-514-8 |
Bicyclo[3.1.1]hept-2-en-6-ol, 2,7,7-trimethyl-, acetate, [1S-(1«alpha»,5«alpha»,6«beta»)]-
|
50764-55-1 |
5 | 161.360 |
| 48-582-3 |
5,5,6-exo,8,8,9,9,10-octachlorocamphene
|
|
5 | 223.660 |
| 48-681-3 |
11«beta»-hydroxy-etiocholanolone, 3«alpha»,11«beta»-dihydroxy-5«beta»-androstane-17-one
|
|
5 | 220.260 |
| 48-703-8 |
1,3-Dioxolo[4,5-b]acridin-10(5H)-one, 4,11-dimethoxy-5-methyl-
|
|
5 | 216.180 |
| 48-774-0 |
Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 3-fluorophenyl ester
|
|
5 | 237.440 |
| 48-798-4 |
Naphthalene,1,2,3,4,4a,5,6,8a-octahydro-4a, 8-dimethyl-2-[1-methylethyl]-
|
|
5 | 196.190 |
| 48-866-8 |
3-Pentene-2-thione,5,5,5-trifluoro-4-hydroxy-
|
88551-99-9 |
5 | 100.240 |
| 48-986-5 |
4-(2,2,6-Trimethyl-1-oxaspiro[4.4]non-6-en-3-yl)-butan-2-one
|
|
5 | 203.630 |
| 49-005-2 |
cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3-methoxy, diacetate
|
|
5 | 255.030 |
| 49-195-2 |
2-exo,3-endo,5-exo,9,9,10,10-heptachlorobornane
|
|
5 | 215.720 |
| 49-279-9 |
7-«alpha»,17-«beta»-Dimethyl-5-«beta»-Androstane-3-«alpha»,17-«alpha»-diol
|
|
5 | 275.050 |
| 49-294-2 |
Perhydrophenanthrene, 1B-(3S,7-dimethyldecyl)-2A,4bB,8,8,10aB-pentamethyl
|
|
5 | 415.070 |
| 49-305-9 |
2,2,4,4-Tetramethyl-6-(3-methylbutanoyl)cyclohexane-1,3,5-trione
|
567-75-9 |
5 | 217.630 |
| 49-549-9 |
1,3,5-Dithiazine, perhydro-2,6-dibutyl-4-methyl
|
|
5 | 211.760 |
| 49-600-1 |
4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (HO-N-acetyl-), isomer 1, propionylated
|
|
5 | 257.360 |
| 49-642-5 |
3-Hydroxy-2,2,4-trimethyl-3-pentenoic acid «beta»-lactone
|
3173-79-3 |
5 | 115.860 |
| 49-653-3 |
3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl), PFBO # 1
|
|
5 | 269.840 |
| 49-688-5 |
(+)-(1S,3aR,7S,7aR)-2,3,3a,4,5,6,7,7a-Octahydro-7,7a-dimethyl-1-(2-methylpropanonyl)-1H-indene
|
|
5 | 202.060 |
| 49-721-7 |
2-Butenoic acid, 3-[[(ethylamino)methoxyphosphinothioyl]oxy]-, 1-methylethyl ester, (E)-
|
31218-83-4 |
5 | 213.430 |
| 49-726-2 |
9-Hydroxymegastigma-4,6-dien-3-one (isomer # 1), «beta»-D-glucopyranoside, TFA
|
|
5 | 425.280 |
| 49-759-6 |
3«alpha»,11«beta»,17«alpha»,21-tetrahydroxy-5«alpha»-pregnane-20-one
|
|
5 | 260.180 |
| 49-825-2 |
2,2,3-exo,5-endo,6-exo,8c,9b,10a-octachlorobornane
|
|
5 | 227.960 |
| 49-859-5 |
1,5,5-Trimethyl-9-oxa-bicyclo[4.3.0]non-2-ene
|
|
5 | 145.700 |
| 50-111-2 |
geranyl 6- O-(«alpha»-L-rhamonopyranosyl)-«beta»-D-glucopyranoside, TFA
|
|
5 | 559.580 |
| 50-135-6 |
Succinic acid, 2-bromo-4-fluorophenyl 2-(dimethylamino)ethyl ester
|
|
5 | 228.490 |
| 50-145-5 |
Glutaric acid, 3,5-dinitro-2-methylbenzyl 2-methylhex-3-yl ester
|
|
5 | 318.620 |
| 50-170-7 |
2,3,4-trifluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester
|
|
5 | 240.570 |
| 50-194-1 |
Methyl-2«beta»-[2'(m-isopropylphenyl)ethyl]-1«beta»,3«alpha»-dimethylcyclohexanecarboxylate
|
|
5 | 279.570 |
| 50-326-4 |
Perhydrophenanthrene, 1B-(3R,7-dimethyldecyl)-2A,4bB,8,8,10aB-pentamethyl
|
|
5 | 415.070 |
| 50-383-1 |
(S)-2-Butyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-[3-o-glucopyranoside
|
|
5 | 266.340 |
| 50-398-5 |
Bicyclo[2.2.1]heptan-2-amine,3-methoxy-N,N-dimethyl-(2-endo,3-exo-)-
|
67425-06-3 |
5 | 145.890 |
| 50-544-2 |
2H-Pyran-2-carboxaldehyde, 3,4-dihydro-2,5-dimethyl-
|
|
5 | 115.860 |
| 50-659-5 |
[4-(4-Trifluoroacetoxy-5-tert-butyl-2-methylphenyl)sulfanyl-2-tert-butyl-5-methylphenyl] trifluoroacetate
|
|
5 | 371.530 |
| 50-813-3 |
4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-), isomer 1, di-TFA
|
|
5 | 231.570 |
| 50-878-2 |
D-Aspartic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester
|
|
5 | 282.690 |
| 50-933-0 |
(4,6-Dichloro-[1,3,5]triazin-2-yl)-(1,1-dimethyl-butyl)-amine
|
|
5 | 178.310 |
| 51-042-8 |
4-(Trifluoromethyl)benzoic acid, 2-methyloct-5-yn-4-yl ester
|
|
5 | 230.780 |
| 51-211-0 |
4-Hepten-3-one, 1,1,2,2-tetrafluoro-5-mercapto-
|
|
5 | 130.190 |
| 51-320-9 |
1,2,3a,3b'a,4,5,6,6aa',6ba'-Decahydro-1a'-isopropyl-3aa'-methyl-6-methylenecyclobuta[1,2:3,4]dicyclopentene
|
|
5 | 185.330 |
| 51-338-0 |
6,8-Dioxabicyclo[3.2.1]octane, 1,5-dimethyl-, (1S)-
|
28401-39-0 |
5 | 113.600 |
| 51-350-6 |
endo-2-(Prop-2-ynyloxycarbonyl)bicyclo[2.2.1]hept-5-ene
|
|
5 | 138.670 |
| 51-387-6 |
2E,4Z-Hexadiene, adduct with 4-methyl-1,2,4-triazolin-3,5-dione
|
|
5 | 144.730 |
| 51-394-8 |
Tricyclo[5.2.1.0(2.6)]deca-3,8-diene, 1,3-dimethyl
|
|
5 | 138.760 |
| 51-566-7 |
2-(Bis(2,2,3,3,3-pentafluoropropanoyl)amino)phenyl 2,2,3,3,3-pentafluoropropanoate
|
|
5 | 245.560 |
| 51-672-9 |
L-Cysteine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester
|
|
5 | 256.770 |
| 51-727-8 |
2,4-Dimethyl-3,4-dihydro-2H-thiopyran-3-carbaldehyde
|
|
5 | 126.340 |
| 52-140-8 |
Methyl (E)-trans-.alpha.-bergamota-2,10-dien-12-oate
|
|
5 | 213.420 |
| 52-373-0 |
Perhydrophenanthrene, 2A,4bB,8,8,10aB-pentamethyl-1A-(3R/S-methyl-7-oxooctyl)
|
|
5 | 374.370 |
| 52-661-0 |
D-Ornithine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester
|
|
5 | 278.580 |
| 52-832-0 |
geranyl 6- O-(«alpha»-L-arabinofuranosyl)-«beta»-D-glucopyranoside, TFA
|
|
5 | 545.490 |
| 52-909-5 |
7,11;8,12-Diepoxy-eremophil-9-ene (epimer B)
|
|
5 | 186.210 |
| 53-070-5 |
Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl 2-methylhex-3-yl ester
|
|
5 | 290.860 |
| 53-180-3 |
Cyclohexyl 2-deoxy-3,4,6-tri-O-methyl-2-(N-methylacetamido)-«beta»-D-glucopyranoside
|
|
5 | 283.660 |
| 53-183-0 |
(-)-2,3,3a,4,5,6-Hexahydro-1,4-dimethylazulen-4-ol
|
|
5 | 155.490 |
| 53-301-8 |
1-(2,2-Dimethyl-1,3-dioxolan-4-yl)-2-methoxy-2-oxoethyl (E)-2-methylbut-2-enoate
|
|
5 | 205.490 |
| 53-399-1 |
2-(2,2,2-trifluoroethyl)-5-chloro-2'-fluorobenzophenone (CFTB)
|
|
5 | 195.580 |
| 53-471-0 |
Decalin-6«beta»-pentanoic acid, «beta»,1,1,5«beta»,7«alpha»-pentamethyl, methyl ester, # 2
|
|
5 | 278.380 |
| 53-497-2 |
cis-1-t-butyl-peroxy-p-mentha-2,8-diene
|
|
5 | 200.400 |
| 53-631-2 |
2,3,4-Trifluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester
|
|
5 | 226.480 |
| 53-638-5 |
4-.beta.-H-cis-Eudesma-6,11-dien-3-.beta.-yl methyl ether
|
|
5 | 211.850 |
| 53-657-4 |
2-Methylbicyclo[2.2.1]-5-heptene-2-carboxylic acid
|
825-03-6 |
5 | 119.090 |
| 53-679-0 |
4-Chloro-N-(2-methyl-4-nitrophenyl)-benzenesulfonamide, N-pentafluoropropionyl-
|
|
5 | 266.930 |
| 53-816-7 |
2-endo,3-exo,5-endo,6-exo,8b,9c,10a,10c-octachlorobornane
|
|
5 | 227.960 |
| 53-826-6 |
3,4-dihydro-8-hydroxy-4,4,7-trimethyl-2(1H)-naphthalenone
|
|
5 | 166.850 |
| 53-917-5 |
2,6-Pyridinedicarboxylic acid, isobutyl 2-methylhex-3-yl ester
|
|
5 | 265.580 |
| 54-050-6 |
2-Buten-1-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)-
|
24720-09-0 |
5 | 176.140 |
| 54-090-2 |
2-Cyclopenten-1-one, 2-hydroxy-3,4,4-trimethyl
|
|
5 | 115.860 |
| 54-378-3 |
Acetic acid 3-acetoxy-5-(acetyl-methyl-amino)-6-methoxy-2-methoxymethyl-tetrahydro-pyran-4-yl ester
|
|
5 | 255.390 |
| 54-420-5 |
1H-2-Indenone,2,4,5,6,7,7a-hexahydro-3-(1-methylethyl)-7a-methyl
|
|
5 | 169.580 |
| 54-439-5 |
2-((2,2,3,3,3-Pentafluoropropanoyl)amino)phenyl 2,2,3,3,3-pentafluoropropanoate
|
|
5 | 192.870 |
| 54-543-9 |
3,3-Dimethylbutan-2-yl (E)-2-methylbut-2-enoate
|
|
5 | 168.990 |
| 54-612-2 |
1-(4-Methyl-4H-[1,3]dithiin-2-yl)-propane-2-thiol
|
|
5 | 157.470 |
| 54-647-4 |
methyl (E)-trans-«alpha»-2,3-epoxybergamota-2,10-dien-12-oate
|
|
5 | 212.730 |
| 54-659-1 |
4-Methoxybenzene-1,3-diamine, N1,N1,N3,N3-tetrakis(trifluoroacetyl)-
|
|
5 | 251.800 |
| 54-784-2 |
11«beta»-hydroxy-androsterone, 3«alpha»,11«beta»-dihydroxy-5«alpha»-androstane-17-one
|
|
5 | 220.260 |
| 54-791-4 |
Italicen-15-al (2,11-cycloacor-3-en-15-al)
|
|
5 | 186.900 |
| 54-949-9 |
5-methyl-1,2,3,4,5,6-hexahydro-7H-cyclopenta[b]pyridin-7-one
|
|
5 | 123.200 |
|
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